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14144-33-3 | Propanoic acid, 3-ethoxy-, methyl ester
CAS No: 14144-33-3 Catalog No: AG001GE7 MDL No:MFCD00072556
Product Description
Catalog Number:
AG001GE7
Chemical Name:
Propanoic acid, 3-ethoxy-, methyl ester
CAS Number:
14144-33-3
Molecular Formula:
C6H12O3
Molecular Weight:
132.1577
MDL Number:
MFCD00072556
IUPAC Name:
methyl 3-ethoxypropanoate
InChI:
InChI=1S/C6H12O3/c1-3-9-5-4-6(7)8-2/h3-5H2,1-2H3
InChI Key:
HSDFKDZBJMDHFF-UHFFFAOYSA-N
SMILES:
CCOCCC(=O)OC
Properties
Complexity:
80.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.079g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
132.159g/mol
Monoisotopic Mass:
132.079g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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